Geometry & MOs

Info

ID:	220409
PubChem CID:	85182446
Reduced:	O3C14H23 (2)
Stoich.:	A3B14C23 (2)
Weight, g/mol:	478.329439
ΔH_f, kcal/mol:	-315.55
Dipole, Da:	4.45
IP(EA), eV:	-10.04(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

15-(5-cyclopropyl-3,4-dihydroxyhexan-2-yl)-4,5-dihydroxy-2,16-dimethyl-9-oxatetracyclo[9.7.0.02,7.012,16]octadecan-8-one

Drug info:

PubChemData

Smile

CC(C1CC1)C(C(C(C)C2CCC3C2(CCC4C3CC(=O)OC5C4(CC(C(C5)O)O)C)C)O)O

DOS

IR

Vibrations